%chk=000134696.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134696

1 1
 O  -0.5231000      0.6889000      9.9999998E-03
 O    2.595900      0.2930000       1.762800    
 O   0.1601000       1.307200       2.122500    
 N   -3.355000     -0.4479000     -0.6422000    
 C   -2.765400      0.9650000     -0.9248000    
 C   -3.823300     -4.3699998E-02  0.7734000    
 C   -1.818700       1.199800      0.2726000    
 C   -2.518100      0.4596000       1.427000    
 C   -3.987100       1.874800     -0.6878000    
 C   -4.702500       1.192800      0.4929000    
 C   -4.477900     -0.8689000      -1.595000    
 C   -2.349400      -1.597900     -0.6819000    
 C   0.3893000      0.8039000       1.029300    
 C    1.738600      0.2142000      0.6197000    
 C    2.357400       1.104900     -0.4435000    
 C    2.502800       2.557600     -1.2000001E-03
 C    3.794200      0.7238000     -0.7857000    
 C    3.521400       3.142000     -0.9751000    
 C    4.344800       1.959800      -1.489200    
 C    1.605700      -1.261600      0.2683000    
 C    1.326600      -1.613400      -1.036000    
 C    1.768100      -2.201000       1.265400    
 C    1.204600      -2.965200      -1.357600    
 C    1.646400      -3.552700      0.9438000    
 C    1.364600      -3.935000     -0.3678000    
 H   -2.314800      0.9949000      -1.919700    
 H   -4.318400     -0.8767000       1.278300    
 H   -1.719600       2.272400      0.4819000    
 H   -2.732500       1.136400       2.261800    
 H   -1.933200     -0.3728000       1.830500    
 H   -4.635000       1.924100      -1.569000    
 H   -3.702300       2.905000     -0.4481000    
 H   -4.773800       1.856300       1.361300    
 H   -5.724500      0.9090000      0.2209000    
 H   -4.904800      -1.803900      -1.219600    
 H   -5.264000     -0.1175000      -1.654300    
 H   -4.037700      -1.014200      -2.586100    
 H   -1.908700      -1.621700      -1.682500    
 H   -1.572700      -1.480800      6.9399998E-02
 H   -2.888600      -2.527800     -0.4760000    
 H    1.758400       1.109000      -1.364000    
 H    2.895700       2.641800       1.018900    
 H    1.557400       3.108500     -3.9600000E-02
 H    3.860300     -0.1588000      -1.429100    
 H    4.395400      0.5270000      0.1095000    
 H    4.150400       3.894700     -0.4888000    
 H    3.012400       3.631900      -1.813100    
 H    4.221800       1.867200      -2.574500    
 H    5.413400       2.090300      -1.290400    
 H    2.058600      0.2116000       2.569400    
 H    1.177000     -0.8869000      -1.826200    
 H    1.969800      -1.943200       2.299600    
 H   0.9795000      -3.262800      -2.377600    
 H    1.766100      -4.308000       1.715100    
 H    1.267200      -4.987400     -0.6179000    


%chk=000134696-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134696

1 1
O -0.572221 0.623006 0.038629
O 2.615133 0.279441 1.824930
O 0.195729 1.564321 2.020732
N -3.417635 -0.499650 -0.618301
C -2.844000 0.945945 -0.853169
C -3.933588 -0.155109 0.827215
C -1.918416 1.145025 0.368838
C -2.629981 0.331693 1.507748
C -4.103706 1.819977 -0.615049
C -4.844540 1.072896 0.558500
C -4.521406 -0.887908 -1.593310
C -2.380719 -1.625711 -0.660357
C 0.429240 0.889660 0.995779
C 1.796871 0.274485 0.613388
C 2.444575 1.165707 -0.502426
C 2.616349 2.661735 -0.117146
C 3.881946 0.683455 -0.887179
C 3.694343 3.151064 -1.113365
C 4.716473 1.981041 -1.146309
C 1.607997 -1.202478 0.208449
C 1.380249 -1.591518 -1.135290
C 1.628422 -2.197409 1.218172
C 1.174020 -2.950577 -1.463417
C 1.418607 -3.556126 0.890254
C 1.187705 -3.939199 -0.451286
H -2.350518 1.029840 -1.831518
H -4.417209 -1.029705 1.286753
H -1.821148 2.212618 0.625078
H -2.848332 0.957350 2.385395
H -1.993692 -0.499880 1.851499
H -4.728331 1.900354 -1.518454
H -3.810591 2.845142 -0.339406
H -4.910354 1.690472 1.467891
H -5.875133 0.791218 0.290607
H -4.847544 -1.912051 -1.354764
H -5.378457 -0.209101 -1.525216
H -4.110707 -0.864311 -2.614610
H -2.172614 -1.864033 -1.714491
H -1.441172 -1.324800 -0.185091
H -2.811671 -2.507022 -0.159548
H 1.785584 1.125880 -1.392791
H 3.006152 2.754415 0.916212
H 1.676124 3.241357 -0.176162
H 3.853639 0.025872 -1.773028
H 4.313848 0.098100 -0.057497
H 4.149895 4.110005 -0.811744
H 3.242515 3.297780 -2.113921
H 5.268738 1.940379 -2.101030
H 5.464515 2.114987 -0.343959
H 2.425585 1.105317 2.343445
H 1.378891 -0.845161 -1.935936
H 1.849890 -1.899332 2.246842
H 1.030936 -3.241021 -2.510536
H 1.456101 -4.316170 1.678239
H 1.046409 -4.994665 -0.708292


